SCHEMBL8994474

SCHEMBL8994474

N#Cc1c(Br)c(-c2ccc(Cl)c(Cl)c2)n(CC2(C(=O)O)CC2)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.35
APP P05067 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
AKR1C3 P42330 1/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
AKR1C2 P52895 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPK14 Q16539 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR5 Q9H228 1/20 0.33
MET P08581 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9058962 0.77 P2RX3 (0.37) CCR2MEN1POLBKMT2AMAPK14
SCHEMBL7501169 0.74 NPC1 (0.38) CCR2CYP2C9POLBS1PR1S1PR5
SCHEMBL8994485 0.74 KDM4E (0.38) CCR2MEN1KMT2AMAPK14S1PR1
SCHEMBL8994475 0.72 MEN1 (0.34) CCR2APPCYP3A4CYP2C9CYP2C19
SCHEMBL8994490 0.72 MAPK14 (0.42) MEN1KMT2AMAPK14METKDR
SCHEMBL8994492 0.70 MAPK14 (0.46) MEN1KMT2AMAPK14IDO1LMNA
SCHEMBL8994399 0.69
SCHEMBL8994380 0.68 POLB (0.34) MEN1POLBKMT2ALMNAMAPT
SCHEMBL8994415 0.67 ALOX5AP (0.33) APPCYP3A4PSEN1PSEN2APH1B
SCHEMBL8994385 0.67 POLB (0.37) PSEN1PSEN2APH1BNCSTNAPH1A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0594941-B1 N-substituted carbonyoxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-08-14 EP claimed